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Specification
The molecular formula is C9H7BrF2O2.
The synonyms are 141134-24-9, 2-Bromo-1-(4-(difluoromethoxy)phenyl)ethanone, 2-bromo-1-[4-(difluoromethoxy)phenyl]ethanone, 4-(difluoromethoxy)phenacyl bromide, and 2-Bromo-4'-(difluoromethoxy)acetophenone.
The molecular weight is 265.05 g/mol.
The IUPAC name is 2-bromo-1-[4-(difluoromethoxy)phenyl]ethanone.
The InChI representation is InChI=1S/C9H7BrF2O2/c10-5-8(13)6-1-3-7(4-2-6)14-9(11)12/h1-4,9H,5H2.
The InChIKey is JMUKUVDYZQDUSP-UHFFFAOYSA-N.
The canonical SMILES is C1=CC(=CC=C1C(=O)CBr)OC(F)F.
The CAS number is 141134-24-9.
The European Community (EC) number is 670-823-3.
Yes, the compound is canonicalized.